A0A5K4F382_SCHMA Loading...

DUF2508 family protein

AlphaFold DB , UniProt , Accession A0A5K4F382, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 93 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M41.5Very low59.6Low233 Ų233129.1 Ų129.1100%1.14869%0.692SS**  085.50-80.2-176.517000106.2S3M1-S3 PolarHBondContact O-N 3.22Å
2D46.3Very low61.7Low155 Ų155130.1 Ų130.183%0.82969%0.69SS**  trans-78.699.3169.5-82.5-34.2000107N4D2-N4 PolarHBondContact O-N 3.24Å
3S53.9Low63.7Low109 Ų109126.1 Ų126.176%0.76267%0.673SS**  trans-70.878.8171.7-63.80000108.2M1 I5M1-S3 PolarHBondContact O-N 3.22Å; S3-I5 VanDerWaalsContact C-N 3.29Å; S3-I5 PolarHBondContact O-N 2.85Å
4N57Low65.1Low145 Ų145120.6 Ų120.678%0.77566%0.655SS**  trans-59.897.9161.4-82.8-32.6000106.8D2 P6D2-N4 PolarHBondContact O-N 3.24Å; N4-P6 VanDerWaalsContact O-CD 3.29Å; N4-P6 WeakPolarHBondContact O-CD 3.44Å; N4-P6 VanDerWaalsContact O-N 3.1Å
5I59.8Low66.7Low128 Ų128119.5 Ų119.566%0.65665%0.653SS**  trans-58.2116.8165.1-60.7176.4000104.7S3 E7 K9S3-I5 VanDerWaalsContact C-N 3.29Å; S3-I5 PolarHBondContact O-N 2.85Å; I5-E7 PolarHBondContact O-N 2.77Å; I5-K9 HydrophobicContact CG2-CB 4.07Å
6P55.4Low68.2Low66 Ų66118.2 Ų118.243%0.42964%0.641SS.*  trans-62.5130.6-175.619.4-24.1000107.8N4 S8 K9N4-P6 VanDerWaalsContact O-CD 3.29Å; N4-P6 WeakPolarHBondContact O-CD 3.44Å; N4-P6 VanDerWaalsContact O-N 3.1Å; P6-S8 PolarHBondContact O-N 3.05Å; P6-K9 HydrophobicContact CG-CB 4.49Å; P6-K9 HydrophobicContact CG-CD 4.32Å; P6-K9 HydrophobicContact CG-CG 4.31Å; P6-K9 WeakPolarHBondContact O-CB 3.29Å; P6-K9 PolarHBondContact O-N 2.9Å
7E62.1Low69.5Low159 Ų159116.6 Ų116.674%0.74363%0.632SS**Hα-helixtrans-46.9-29.6-178.4-147.3170.9-165.900112.5I5 N10 N11I5-E7 PolarHBondContact O-N 2.77Å; E7-N10 PolarHBondContact O-N 2.91Å; E7-N11 PolarHBondContact O-N 3.27Å
8S64.4Low70.5Confident79 Ų79114.1 Ų114.155%0.55262%0.621SS**Hα-helixtrans-61.1-38.8172.7670000114.5P6 N10 Q12P6-S8 PolarHBondContact O-N 3.05Å; S8-N10 VanDerWaalsContact C-N 3.34Å; S8-Q12 WeakPolarHBondContact O-CB 3.32Å; S8-Q12 PolarHBondContact O-N 2.98Å
9K63.6Low71.6Confident129 Ų129115 Ų11556%0.56162%0.615SS**Hα-helixtrans-65.5-39.3174.9-91-173.5175-179.50111.3I5 P6 Q12 T13I5-K9 HydrophobicContact CG2-CB 4.07Å; P6-K9 HydrophobicContact CG-CB 4.49Å; P6-K9 HydrophobicContact CG-CD 4.32Å; P6-K9 HydrophobicContact CG-CG 4.31Å; P6-K9 WeakPolarHBondContact O-CB 3.29Å; P6-K9 PolarHBondContact O-N 2.9Å; K9-Q12 PolarHBondContact O-N 3.08Å; K9-T13 PolarHBondContact O-N 3.01Å; K9-T13 PolarHBondContact O-OG1 3.33Å; K9-T13 VanDerWaalsContact O-OG1 3.08Å
10N72.9Confident72.5Confident113 Ų113113.2 Ų113.260%0.60460%0.603SS**Hα-helixtrans-68-42.4-179.4-142.319.3000111.1E7 S8 Q12 T13 A14E7-N10 PolarHBondContact O-N 2.91Å; S8-N10 VanDerWaalsContact C-N 3.34Å; N10-Q12 VanDerWaalsContact C-N 3.33Å; N10-Q12 PolarHBondContact O-N 3.47Å; N10-T13 PolarHBondContact O-N 3.05Å; N10-A14 PolarHBondContact O-N 3.42Å
11N79.1Confident73.2Confident104 Ų104114.2 Ų114.256%0.55660%0.604SS**Hα-helixtrans-63.8-38.6173.8-72.3-16.1000112.1E7 A14 V15E7-N11 PolarHBondContact O-N 3.27Å; N11-A14 PolarHBondContact O-N 3.02Å; N11-V15 VanDerWaalsContact O-CG2 3.28Å; N11-V15 WeakPolarHBondContact O-CG2 3.28Å; N11-V15 PolarHBondContact O-N 3.43Å
12Q84.1Confident75.4Confident141 Ų141109.2 Ų109.266%0.65958%0.58SS**Hα-helixtrans-67.3-40.1178.9-163.7169.611.900112.1S8 K9 N10 V15 E16S8-Q12 WeakPolarHBondContact O-CB 3.32Å; S8-Q12 PolarHBondContact O-N 2.98Å; K9-Q12 PolarHBondContact O-N 3.08Å; N10-Q12 VanDerWaalsContact C-N 3.33Å; N10-Q12 PolarHBondContact O-N 3.47Å; Q12-V15 PolarHBondContact O-N 3.38Å; Q12-E16 PolarHBondContact O-N 3Å
13T87.8Confident77.5Confident78 Ų78107.7 Ų107.748%0.47956%0.562SS.*Hα-helixtrans-63.6-43.7173.3-56.20000111.5K9 N10 V15 E16 D17K9-T13 PolarHBondContact O-N 3.01Å; K9-T13 PolarHBondContact O-OG1 3.33Å; K9-T13 VanDerWaalsContact O-OG1 3.08Å; N10-T13 PolarHBondContact O-N 3.05Å; T13-V15 VanDerWaalsContact C-N 3.33Å; T13-V15 PolarHBondContact O-N 2.89Å; T13-E16 PolarHBondContact O-N 3.24Å; T13-D17 PolarHBondContact O-N 3.4Å
14A83.9Confident78.9Confident50 Ų50109.3 Ų109.341%0.41356%0.556SS.*Hα-helixtrans-62.5-38.717800000112.8N10 N11 T18N10-A14 PolarHBondContact O-N 3.42Å; N11-A14 PolarHBondContact O-N 3.02Å; A14-T18 WeakPolarHBondContact O-CB 3.44Å; A14-T18 PolarHBondContact O-N 3.14Å; A14-T18 PolarHBondContact O-OG1 3.39Å
15V89.3Confident80.1Confident103 Ų103108.5 Ų108.562%0.62455%0.55SS**Hα-helixtrans-66.2-43.9175.3170.70000111N11 Q12 T13 T18 Y19N11-V15 VanDerWaalsContact O-CG2 3.28Å; N11-V15 WeakPolarHBondContact O-CG2 3.28Å; N11-V15 PolarHBondContact O-N 3.43Å; Q12-V15 PolarHBondContact O-N 3.38Å; T13-V15 VanDerWaalsContact C-N 3.33Å; T13-V15 PolarHBondContact O-N 2.89Å; V15-T18 PolarHBondContact O-N 2.99Å; V15-Y19 WeakPolarHBondContact O-CB 3.41Å; V15-Y19 PolarHBondContact O-N 2.75Å
16E90.7Very high81Confident99 Ų99106.2 Ų106.246%0.46355%0.545SS..Hα-helixtrans-63.2-44.8177.5-172.261.7-145.300111.4Q12 T13 T18 Y19 Q20Q12-E16 PolarHBondContact O-N 3Å; T13-E16 PolarHBondContact O-N 3.24Å; E16-T18 VanDerWaalsContact C-N 3.31Å; E16-T18 PolarHBondContact O-N 3.5Å; E16-Y19 WeakPolarHBondContact O-CB 3.45Å; E16-Y19 PolarHBondContact O-N 3.33Å; E16-Y19 VanDerWaalsContact O-N 3.14Å; E16-Q20 WeakPolarHBondContact O-CG 3.39Å; E16-Q20 PolarHBondContact O-N 3.02Å; E16-Q20 PolarHBondContact OE1-NE2 3.39Å
17D89.4Confident82.2Confident91 Ų91108 Ų10849%0.48755%0.548SS..Hα-helixtrans-60.5-42.1176.5-78.3-17.4000111.6T13 Y19 Q20 Q21T13-D17 PolarHBondContact O-N 3.4Å; D17-Y19 VanDerWaalsContact C-N 3.34Å; D17-Y19 PolarHBondContact O-N 2.9Å; D17-Q20 PolarHBondContact O-N 2.82Å; D17-Q21 VanDerWaalsContact O-CG 3.3Å; D17-Q21 WeakPolarHBondContact O-CG 3.3Å; D17-Q21 PolarHBondContact O-N 2.89Å
18T88.6Confident83Confident71 Ų71104.5 Ų104.544%0.43653%0.534SS..Hα-helixtrans-63-42.4175.9-56.60000111A14 V15 E16 Q21 M22A14-T18 WeakPolarHBondContact O-CB 3.44Å; A14-T18 PolarHBondContact O-N 3.14Å; A14-T18 PolarHBondContact O-OG1 3.39Å; V15-T18 PolarHBondContact O-N 2.99Å; E16-T18 VanDerWaalsContact C-N 3.31Å; E16-T18 PolarHBondContact O-N 3.5Å; T18-Q21 PolarHBondContact O-N 3.3Å; T18-M22 PolarHBondContact O-N 2.89Å
19Y91.5Very high83.6Confident132 Ų132108.7 Ų108.752%0.51854%0.539SS..Hα-helixtrans-63-44.9177.3179.7-98.5000111.9V15 E16 D17 Q21 M22 R23V15-Y19 WeakPolarHBondContact O-CB 3.41Å; V15-Y19 PolarHBondContact O-N 2.75Å; E16-Y19 WeakPolarHBondContact O-CB 3.45Å; E16-Y19 PolarHBondContact O-N 3.33Å; E16-Y19 VanDerWaalsContact O-N 3.14Å; D17-Y19 VanDerWaalsContact C-N 3.34Å; D17-Y19 PolarHBondContact O-N 2.9Å; Y19-Q21 VanDerWaalsContact C-N 3.33Å; Y19-Q21 PolarHBondContact O-N 3.36Å; Y19-M22 PolarHBondContact O-N 3.43Å; Y19-R23 WeakPolarHBondContact O-CB 3.47Å; Y19-R23 PolarHBondContact O-N 3.23Å
20Q89.6Confident84.2Confident79 Ų79109.2 Ų109.237%0.36954%0.541SS..Hα-helixtrans-64-38.4177.3-65.9-56.5-2800112E16 D17 R23 K24E16-Q20 WeakPolarHBondContact O-CG 3.39Å; E16-Q20 PolarHBondContact O-N 3.02Å; E16-Q20 PolarHBondContact OE1-NE2 3.39Å; D17-Q20 PolarHBondContact O-N 2.82Å; Q20-R23 PolarHBondContact O-N 3.06Å; Q20-K24 PolarHBondContact O-N 2.97Å
21Q87.3Confident84.2Confident135 Ų135109.2 Ų109.263%0.63154%0.541SS*.Hα-helixtrans-62.9-47.1174.2-73176.142.700111.8D17 T18 Y19 R23 K24 L25D17-Q21 VanDerWaalsContact O-CG 3.3Å; D17-Q21 WeakPolarHBondContact O-CG 3.3Å; D17-Q21 PolarHBondContact O-N 2.89Å; T18-Q21 PolarHBondContact O-N 3.3Å; Y19-Q21 VanDerWaalsContact C-N 3.33Å; Y19-Q21 PolarHBondContact O-N 3.36Å; Q21-R23 VanDerWaalsContact C-N 3.33Å; Q21-R23 PolarHBondContact O-N 3.31Å; Q21-K24 PolarHBondContact O-N 3.45Å; Q21-L25 PolarHBondContact O-N 3.4Å
22M87.7Confident83.7Confident127 Ų127110 Ų11063%0.62654%0.539SS*.Hα-helixtrans-60.7-41.7176-79-174.7171.400112.1T18 Y19 K24 L25 C26T18-M22 PolarHBondContact O-N 2.89Å; Y19-M22 PolarHBondContact O-N 3.43Å; M22-K24 PolarHBondContact O-N 3.46Å; M22-L25 WeakPolarHBondContact O-CB 3.41Å; M22-L25 PolarHBondContact O-N 3.04Å; M22-C26 PolarHBondContact O-N 2.95Å
23R88.5Confident82.9Confident124 Ų124105.4 Ų105.447%0.46852%0.523SS..Hα-helixtrans-59.6-46.8177.5-170.2-177.2-166.2161.510.8111.6Y19 Q20 Q21 L25 C26 E27Y19-R23 WeakPolarHBondContact O-CB 3.47Å; Y19-R23 PolarHBondContact O-N 3.23Å; Q20-R23 PolarHBondContact O-N 3.06Å; Q21-R23 VanDerWaalsContact C-N 3.33Å; Q21-R23 PolarHBondContact O-N 3.31Å; R23-L25 VanDerWaalsContact C-N 3.28Å; R23-L25 PolarHBondContact O-N 3.49Å; R23-C26 PolarHBondContact O-N 3.39Å; R23-E27 IonicContact NE-OE1 3.75Å; R23-E27 WeakPolarHBondContact O-CG 3.47Å; R23-E27 PolarHBondContact O-N 3.43Å
24K84.9Confident81.8Confident143 Ų143109.5 Ų109.562%0.62253%0.534SS*.Hα-helixtrans-62-37.9178.3-146176.4-170.9179.60111.7Q20 Q21 M22 E27 N28Q20-K24 PolarHBondContact O-N 2.97Å; Q21-K24 PolarHBondContact O-N 3.45Å; M22-K24 PolarHBondContact O-N 3.46Å; K24-E27 PolarHBondContact O-N 3.23Å; K24-N28 PolarHBondContact O-N 2.98Å
25L81.1Confident80.5Confident127 Ų127110.5 Ų110.567%0.66553%0.532SS*.Hα-helixtrans-66.1-42.9176.9-146.4143.1000111.4Q21 M22 R23 N28 Y29Q21-L25 PolarHBondContact O-N 3.4Å; M22-L25 WeakPolarHBondContact O-CB 3.41Å; M22-L25 PolarHBondContact O-N 3.04Å; R23-L25 VanDerWaalsContact C-N 3.28Å; R23-L25 PolarHBondContact O-N 3.49Å; L25-N28 PolarHBondContact O-N 3.39Å; L25-Y29 PolarHBondContact O-N 2.99Å
26C80.1Confident78.8Confident81 Ų81110.3 Ų110.355%0.54753%0.528SS..Hα-helixtrans-64.5-38.7173-80.70000113.4M22 R23 Y29 K30M22-C26 PolarHBondContact O-N 2.95Å; R23-C26 PolarHBondContact O-N 3.39Å; C26-Y29 PolarHBondContact O-N 2.92Å; C26-K30 PolarHBondContact O-N 3.03Å
27E80.2Confident77.1Confident102 Ų102112.7 Ų112.748%0.47754%0.543SS..Hα-helixtrans-65.4-44.4177.1-76.4174.2-178.900111.6R23 K24 Y29 K30 L31R23-E27 IonicContact NE-OE1 3.75Å; R23-E27 WeakPolarHBondContact O-CG 3.47Å; R23-E27 PolarHBondContact O-N 3.43Å; K24-E27 PolarHBondContact O-N 3.23Å; E27-Y29 PolarHBondContact O-N 3.35Å; E27-K30 PolarHBondContact O-N 3.5Å; E27-L31 PolarHBondContact O-N 3.08Å; E27-L31 VanDerWaalsContact O-N 3.08Å
28N78.9Confident75.6Confident86 Ų86112.9 Ų112.946%0.4654%0.544SS..Hα-helixtrans-60.4-45.6173.5-79.6-14.1000111.4K24 L25 K30 L31 F32K24-N28 PolarHBondContact O-N 2.98Å; L25-N28 PolarHBondContact O-N 3.39Å; N28-K30 VanDerWaalsContact C-N 3.3Å; N28-K30 PolarHBondContact O-N 3.28Å; N28-L31 VanDerWaalsContact O-CB 3.3Å; N28-L31 WeakPolarHBondContact O-CB 3.47Å; N28-L31 PolarHBondContact O-N 3.01Å; N28-F32 WeakPolarHBondContact O-CD2 3.3Å; N28-F32 PolarHBondContact O-N 3.07Å
29Y76.4Confident74.2Confident167 Ų167111.7 Ų111.766%0.65554%0.539SS*.Hα-helixtrans-58.6-42.2177.5-171.4-88.5000112L25 C26 E27 L31 F32 S33L25-Y29 PolarHBondContact O-N 2.99Å; C26-Y29 PolarHBondContact O-N 2.92Å; E27-Y29 PolarHBondContact O-N 3.35Å; Y29-L31 VanDerWaalsContact C-N 3.29Å; Y29-L31 PolarHBondContact O-N 3.47Å; Y29-F32 PolarHBondContact O-N 3.46Å; Y29-S33 WeakPolarHBondContact O-CB 3.3Å; Y29-S33 PolarHBondContact O-N 3.27Å; Y29-S33 PolarHBondContact O-OG 3.4Å
30K75.9Confident72.9Confident141 Ų141111.2 Ų111.261%0.61355%0.546SS*.Hα-helixtrans-63.7-33.4175.7-77.4179.6-180177.30113.3C26 E27 N28 S33 K34C26-K30 PolarHBondContact O-N 3.03Å; E27-K30 PolarHBondContact O-N 3.5Å; N28-K30 VanDerWaalsContact C-N 3.3Å; N28-K30 PolarHBondContact O-N 3.28Å; K30-S33 WeakPolarHBondContact CA-OG 3.14Å; K30-S33 PolarHBondContact O-OG 3.14Å; K30-K34 WeakPolarHBondContact O-CB 3.48Å; K30-K34 WeakPolarHBondContact O-CG 3.37Å; K30-K34 PolarHBondContact O-N 3.26Å; K30-K34 VanDerWaalsContact O-N 3.14Å
31L73.9Confident72.1Confident113 Ų113111.1 Ų111.159%0.59255%0.548SS*.Hα-helixtrans-64.9-46.9174.5-107.5146.2000110.6E27 N28 Y29 K34 L35E27-L31 PolarHBondContact O-N 3.08Å; E27-L31 VanDerWaalsContact O-N 3.08Å; N28-L31 VanDerWaalsContact O-CB 3.3Å; N28-L31 WeakPolarHBondContact O-CB 3.47Å; N28-L31 PolarHBondContact O-N 3.01Å; Y29-L31 VanDerWaalsContact C-N 3.29Å; Y29-L31 PolarHBondContact O-N 3.47Å; L31-K34 PolarHBondContact O-N 2.76Å; L31-L35 PolarHBondContact O-N 3.32Å
32F67.6Low71.4Confident119 Ų119107.6 Ų107.652%0.52253%0.533SS..Hα-helixtrans-70-37.7176.3-71.2-67.4000113.1N28 Y29 K34 L35 D36N28-F32 WeakPolarHBondContact O-CD2 3.3Å; N28-F32 PolarHBondContact O-N 3.07Å; Y29-F32 PolarHBondContact O-N 3.46Å; F32-K34 PolarHBondContact O-N 3.09Å; F32-L35 HydrophobicContact CD1-CD1 4.28Å; F32-L35 WeakPolarHBondContact O-CA 3.34Å; F32-L35 VanDerWaalsContact O-CB 3.3Å; F32-L35 WeakPolarHBondContact O-CB 3.31Å; F32-L35 PolarHBondContact O-N 3.33Å; F32-L35 VanDerWaalsContact O-N 3.09Å; F32-D36 PolarHBondContact O-N 3.47Å
33S67.4Low70.9Confident46 Ų46106.1 Ų106.132%0.32253%0.528SS..Hα-helixtrans-69.7-23.7178.479.80000112.6Y29 K30 D36Y29-S33 WeakPolarHBondContact O-CB 3.3Å; Y29-S33 PolarHBondContact O-N 3.27Å; Y29-S33 PolarHBondContact O-OG 3.4Å; K30-S33 WeakPolarHBondContact CA-OG 3.14Å; K30-S33 PolarHBondContact O-OG 3.14Å; S33-D36 VanDerWaalsContact O-CB 3.31Å; S33-D36 WeakPolarHBondContact O-CB 3.47Å; S33-D36 PolarHBondContact O-N 3.07Å
34K65.2Low70.4Confident164 Ų164106.3 Ų106.371%0.71353%0.534SS*.Hα-helixtrans-75.7-31.9170.9-81.4-178.4178.3-175.70112.1K30 L31 F32 N37K30-K34 WeakPolarHBondContact O-CB 3.48Å; K30-K34 WeakPolarHBondContact O-CG 3.37Å; K30-K34 PolarHBondContact O-N 3.26Å; K30-K34 VanDerWaalsContact O-N 3.14Å; L31-K34 PolarHBondContact O-N 2.76Å; F32-K34 PolarHBondContact O-N 3.09Å; K34-N37 PolarHBondContact O-N 2.78Å
35L57.1Low70.1Confident71 Ų71105.4 Ų105.437%0.37254%0.535SS..Hα-helixtrans-66.6-26.2169.2-82.1154.2000111.6L31 F32 N37 N38 L42L31-L35 PolarHBondContact O-N 3.32Å; F32-L35 HydrophobicContact CD1-CD1 4.28Å; F32-L35 WeakPolarHBondContact O-CA 3.34Å; F32-L35 VanDerWaalsContact O-CB 3.3Å; F32-L35 WeakPolarHBondContact O-CB 3.31Å; F32-L35 PolarHBondContact O-N 3.33Å; F32-L35 VanDerWaalsContact O-N 3.09Å; L35-N37 PolarHBondContact O-N 3.21Å; L35-N38 CarbonylContact O-C 3.04Å; L35-N38 WeakPolarHBondContact O-CA 3.41Å; L35-N38 WeakPolarHBondContact O-CB 3.22Å; L35-N38 PolarHBondContact O-N 3.43Å; L35-L42 HydrophobicContact CB-CD1 4.12Å
36D53.1Low70.1Confident98 Ų98106.4 Ų106.452%0.52453%0.531SS..G310 helixtrans-64.6-18.9176.6-137.28.7000113.7F32 S33 N38 S39F32-D36 PolarHBondContact O-N 3.47Å; S33-D36 VanDerWaalsContact O-CB 3.31Å; S33-D36 WeakPolarHBondContact O-CB 3.47Å; S33-D36 PolarHBondContact O-N 3.07Å; D36-N38 PolarHBondContact O-N 3.01Å; D36-S39 WeakPolarHBondContact O-CB 3.36Å; D36-S39 PolarHBondContact O-N 3.35Å
37N54.3Low70.1Confident149 Ų149105.3 Ų105.380%0.79752%0.524SS*.G310 helixtrans-70.6-14.7167-76.7-26.2000112.9K34 L35K34-N37 PolarHBondContact O-N 2.78Å; L35-N37 PolarHBondContact O-N 3.21Å
38N58Low70.2Confident95 Ų95103.8 Ų103.851%0.50852%0.522SS..G310 helixtrans-111.949.8161.3-70.90.3000108.8L35 D36 N40 D41L35-N38 CarbonylContact O-C 3.04Å; L35-N38 WeakPolarHBondContact O-CA 3.41Å; L35-N38 WeakPolarHBondContact O-CB 3.22Å; L35-N38 PolarHBondContact O-N 3.43Å; D36-N38 PolarHBondContact O-N 3.01Å; N38-N40 PolarHBondContact O-N 2.68Å; N38-D41 HydrophobicContact CB-CB 4.42Å; N38-D41 WeakPolarHBondContact CB-OD2 3.32Å; N38-D41 PolarHBondContact ND2-OD2 2.74Å; N38-D41 PolarHBondContact O-N 2.88Å
39S59Low70.5Confident47 Ų47102.7 Ų102.733%0.32952%0.521SS..Hα-helixtrans-49.3-28-17582.90000113.6D36 D41 L42 D43D36-S39 WeakPolarHBondContact O-CB 3.36Å; D36-S39 PolarHBondContact O-N 3.35Å; S39-D41 VanDerWaalsContact C-N 3.27Å; S39-D41 PolarHBondContact O-N 2.82Å; S39-L42 PolarHBondContact O-N 3.14Å; S39-D43 PolarHBondContact O-N 3.37Å; S39-D43 VanDerWaalsContact O-N 3.14Å
40N65.5Low70.9Confident122 Ų12297.7 Ų97.765%0.65251%0.505SS*.Hα-helixtrans-53.5-38.1171.9-77.6-0.8000113.6N38 E44N38-N40 PolarHBondContact O-N 2.68Å; N40-E44 WeakPolarHBondContact O-CA 3.23Å; N40-E44 WeakPolarHBondContact O-CB 3.34Å; N40-E44 PolarHBondContact O-N 3.28Å
41D72.6Confident71.6Confident77 Ų7795.4 Ų95.441%0.41250%0.5SS..Hα-helixtrans-68.5-39.9-175-66.2-14.5000111.4N38 S39 L45N38-D41 HydrophobicContact CB-CB 4.42Å; N38-D41 WeakPolarHBondContact CB-OD2 3.32Å; N38-D41 PolarHBondContact ND2-OD2 2.74Å; N38-D41 PolarHBondContact O-N 2.88Å; S39-D41 VanDerWaalsContact C-N 3.27Å; S39-D41 PolarHBondContact O-N 2.82Å; D41-L45 VanDerWaalsContact O-CB 3.32Å; D41-L45 WeakPolarHBondContact O-CB 3.36Å; D41-L45 PolarHBondContact O-N 2.84Å
42L72.8Confident72.4Confident61 Ų6195.1 Ų95.132%0.31950%0.498SS..Hα-helixtrans-75.3-42.8178.6-82.4167.4000111.8L35 S39 E44 L45 Y46L35-L42 HydrophobicContact CB-CD1 4.12Å; S39-L42 PolarHBondContact O-N 3.14Å; L42-E44 VanDerWaalsContact C-N 3.32Å; L42-L45 PolarHBondContact O-N 3.33Å; L42-Y46 WeakPolarHBondContact O-CB 3.44Å; L42-Y46 PolarHBondContact O-N 3.06Å
43D77.1Confident73.4Confident96 Ų9691.3 Ų91.351%0.51349%0.487SS..Hα-helixtrans-65.2-37.3176-73.4-26.3000111.4S39 S47S39-D43 PolarHBondContact O-N 3.37Å; S39-D43 VanDerWaalsContact O-N 3.14Å; D43-S47 VanDerWaalsContact O-CB 3.23Å; D43-S47 WeakPolarHBondContact O-CB 3.41Å; D43-S47 PolarHBondContact O-N 2.99Å; D43-S47 PolarHBondContact O-OG 2.79Å
44E78.1Confident74.6Confident127 Ų12795.3 Ų95.359%0.59350%0.495SS*.Hα-helixtrans-67.7-42.4174-176.2174.2-171.400111.3N40 L42 S47 T48N40-E44 WeakPolarHBondContact O-CA 3.23Å; N40-E44 WeakPolarHBondContact O-CB 3.34Å; N40-E44 PolarHBondContact O-N 3.28Å; L42-E44 VanDerWaalsContact C-N 3.32Å; E44-S47 PolarHBondContact O-N 3.44Å; E44-T48 VanDerWaalsContact O-CB 3.25Å; E44-T48 WeakPolarHBondContact O-CB 3.41Å; E44-T48 PolarHBondContact O-N 3.47Å; E44-T48 PolarHBondContact O-OG1 3.34Å
45L78.6Confident75.9Confident125 Ų12592.6 Ų92.665%0.65449%0.488SS*.Hα-helixtrans-62.8-44.1175.6-161.6102.5000111.3D41 L42 T48 S49D41-L45 VanDerWaalsContact O-CB 3.32Å; D41-L45 WeakPolarHBondContact O-CB 3.36Å; D41-L45 PolarHBondContact O-N 2.84Å; L42-L45 PolarHBondContact O-N 3.33Å; L45-T48 PolarHBondContact O-N 2.87Å; L45-S49 WeakPolarHBondContact O-CB 3.25Å; L45-S49 PolarHBondContact O-N 2.91Å
46Y79.9Confident77.6Confident148 Ų14896.4 Ų96.458%0.5850%0.497SS*.Hα-helixtrans-62.3-48.7175.6178.1-104000111.2L42 T48 S49 L50L42-Y46 WeakPolarHBondContact O-CB 3.44Å; L42-Y46 PolarHBondContact O-N 3.06Å; Y46-T48 VanDerWaalsContact C-N 3.32Å; Y46-T48 PolarHBondContact O-N 3.1Å; Y46-S49 PolarHBondContact O-N 3.14Å; Y46-S49 VanDerWaalsContact O-N 3.14Å; Y46-S49 PolarHBondContact O-OG 2.93Å; Y46-L50 PolarHBondContact O-N 3.32Å
47S80.5Confident79.5Confident58 Ų5895 Ų9541%0.40649%0.49SS..Hα-helixtrans-61.2-40.6178.1-61.10000112D43 E44 L50 N51D43-S47 VanDerWaalsContact O-CB 3.23Å; D43-S47 WeakPolarHBondContact O-CB 3.41Å; D43-S47 PolarHBondContact O-N 2.99Å; D43-S47 PolarHBondContact O-OG 2.79Å; E44-S47 PolarHBondContact O-N 3.44Å; S47-L50 PolarHBondContact O-N 3.44Å; S47-N51 WeakPolarHBondContact O-CB 3.35Å; S47-N51 VanDerWaalsContact O-CG 3.28Å; S47-N51 PolarHBondContact O-N 3.4Å; S47-N51 PolarHBondContact O-ND2 3.01Å
48T83.3Confident81.5Confident70 Ų7092.7 Ų92.743%0.42948%0.477SS..Hα-helixtrans-62.5-45174.4-61.10000110.9E44 L45 Y46 L50 N51 L52E44-T48 VanDerWaalsContact O-CB 3.25Å; E44-T48 WeakPolarHBondContact O-CB 3.41Å; E44-T48 PolarHBondContact O-N 3.47Å; E44-T48 PolarHBondContact O-OG1 3.34Å; L45-T48 PolarHBondContact O-N 2.87Å; Y46-T48 VanDerWaalsContact C-N 3.32Å; Y46-T48 PolarHBondContact O-N 3.1Å; T48-L50 VanDerWaalsContact C-N 3.31Å; T48-L50 PolarHBondContact O-N 2.92Å; T48-N51 PolarHBondContact O-N 3.43Å; T48-L52 HydrophobicContact CG2-CD1 4.21Å; T48-L52 WeakPolarHBondContact O-CG 3.47Å; T48-L52 PolarHBondContact O-N 3.42Å
49S84.5Confident83.4Confident62 Ų6294.9 Ų94.943%0.43448%0.479SS..Hα-helixtrans-62.8-38.4177.678.40000112.4L45 Y46 L52 S53L45-S49 WeakPolarHBondContact O-CB 3.25Å; L45-S49 PolarHBondContact O-N 2.91Å; Y46-S49 PolarHBondContact O-N 3.14Å; Y46-S49 VanDerWaalsContact O-N 3.14Å; Y46-S49 PolarHBondContact O-OG 2.93Å; S49-L52 PolarHBondContact O-N 2.91Å; S49-S53 PolarHBondContact O-N 3.43Å
50L85.4Confident85.3Confident62 Ų6297 Ų9733%0.32548%0.484SS..Hα-helixtrans-65.8-46.8176.2-173.267.9000110.9Y46 S47 T48 L52 S53 Y54Y46-L50 PolarHBondContact O-N 3.32Å; S47-L50 PolarHBondContact O-N 3.44Å; T48-L50 VanDerWaalsContact C-N 3.31Å; T48-L50 PolarHBondContact O-N 2.92Å; L50-L52 VanDerWaalsContact C-N 3.32Å; L50-L52 PolarHBondContact O-N 2.79Å; L50-S53 WeakPolarHBondContact O-CB 3Å; L50-S53 PolarHBondContact O-N 3.39Å; L50-S53 VanDerWaalsContact O-N 3.1Å; L50-Y54 HydrophobicContact CD1-CE2 4.1Å; L50-Y54 HydrophobicContact CD2-CE2 3.99Å; L50-Y54 HydrophobicContact CG-CD2 4.27Å; L50-Y54 HydrophobicContact CG-CE2 3.6Å; L50-Y54 WeakPolarHBondContact O-CD2 3.44Å; L50-Y54 PolarHBondContact O-N 3.29Å
51N90.3Very high86.8Confident94 Ų9494.8 Ų94.850%0.50348%0.475SS..Hα-helixtrans-59.5-41.5175.7-73.4-19.7000112.1S47 T48 S53 Y54 I55S47-N51 WeakPolarHBondContact O-CB 3.35Å; S47-N51 VanDerWaalsContact O-CG 3.28Å; S47-N51 PolarHBondContact O-N 3.4Å; S47-N51 PolarHBondContact O-ND2 3.01Å; T48-N51 PolarHBondContact O-N 3.43Å; N51-S53 VanDerWaalsContact C-N 3.31Å; N51-S53 PolarHBondContact O-N 2.77Å; N51-Y54 PolarHBondContact O-N 3.05Å; N51-I55 WeakPolarHBondContact O-CG1 3.45Å; N51-I55 PolarHBondContact O-N 2.88Å
52L89.4Confident88Confident107 Ų10796.5 Ų96.556%0.5648%0.483SS*.Hα-helixtrans-64.4-35.8175.2-73172.4000112.2T48 S49 L50 I55 R56T48-L52 HydrophobicContact CG2-CD1 4.21Å; T48-L52 WeakPolarHBondContact O-CG 3.47Å; T48-L52 PolarHBondContact O-N 3.42Å; S49-L52 PolarHBondContact O-N 2.91Å; L50-L52 VanDerWaalsContact C-N 3.32Å; L50-L52 PolarHBondContact O-N 2.79Å; L52-I55 PolarHBondContact O-N 3.03Å; L52-R56 PolarHBondContact O-N 2.85Å
53S90.1Very high89.2Confident39 Ų3998.5 Ų98.527%0.27349%0.489SS..Hα-helixtrans-62.8-45.8173.4-167.60000111.2S49 L50 N51 I55 R56 D57S49-S53 PolarHBondContact O-N 3.43Å; L50-S53 WeakPolarHBondContact O-CB 3Å; L50-S53 PolarHBondContact O-N 3.39Å; L50-S53 VanDerWaalsContact O-N 3.1Å; N51-S53 VanDerWaalsContact C-N 3.31Å; N51-S53 PolarHBondContact O-N 2.77Å; S53-I55 PolarHBondContact O-N 3.37Å; S53-R56 WeakPolarHBondContact O-CB 3.47Å; S53-R56 PolarHBondContact O-N 3.16Å; S53-R56 PolarHBondContact OG-NH2 3.04Å; S53-D57 PolarHBondContact O-N 3.47Å
54Y91.1Very high90.2Very high129 Ų129100 Ų10051%0.50649%0.493SS..Hα-helixtrans-61.8-42.8177-66-45000112.4L50 N51 R56 D57 D58L50-Y54 HydrophobicContact CD1-CE2 4.1Å; L50-Y54 HydrophobicContact CD2-CE2 3.99Å; L50-Y54 HydrophobicContact CG-CD2 4.27Å; L50-Y54 HydrophobicContact CG-CE2 3.6Å; L50-Y54 WeakPolarHBondContact O-CD2 3.44Å; L50-Y54 PolarHBondContact O-N 3.29Å; N51-Y54 PolarHBondContact O-N 3.05Å; Y54-R56 VanDerWaalsContact C-N 3.28Å; Y54-R56 PolarHBondContact O-N 2.97Å; Y54-D57 PolarHBondContact O-N 3.46Å; Y54-D57 VanDerWaalsContact O-N 3.16Å; Y54-D58 WeakPolarHBondContact O-CB 3.49Å; Y54-D58 PolarHBondContact O-N 3.28Å
55I93.5Very high91.2Very high108 Ų10899.2 Ų99.255%0.55449%0.489SS*.Hα-helixtrans-59.5-40.3175.5-69.1165.6000111.4N51 L52 S53 Y59N51-I55 WeakPolarHBondContact O-CG1 3.45Å; N51-I55 PolarHBondContact O-N 2.88Å; L52-I55 PolarHBondContact O-N 3.03Å; S53-I55 PolarHBondContact O-N 3.37Å; I55-Y59 WeakPolarHBondContact O-CB 3.43Å; I55-Y59 PolarHBondContact O-N 3.04Å
56R92.6Very high92.1Very high150 Ų15097.6 Ų97.657%0.56648%0.481SS*.Hα-helixtrans-64.9-43.3176.4-175.7-163.766.6-162-7.4111.4L52 S53 Y54 Y59 E60L52-R56 PolarHBondContact O-N 2.85Å; S53-R56 WeakPolarHBondContact O-CB 3.47Å; S53-R56 PolarHBondContact O-N 3.16Å; S53-R56 PolarHBondContact OG-NH2 3.04Å; Y54-R56 VanDerWaalsContact C-N 3.28Å; Y54-R56 PolarHBondContact O-N 2.97Å; R56-Y59 WeakPolarHBondContact O-CB 3.48Å; R56-Y59 PolarHBondContact O-N 3.34Å; R56-E60 PolarHBondContact O-N 3.19Å
57D93.4Very high93Very high69 Ų6994.1 Ų94.137%0.36948%0.478SS..Hα-helixtrans-69.1-38.3-178.3-61-13.3000110.8S53 Y54 E60 T61S53-D57 PolarHBondContact O-N 3.47Å; Y54-D57 PolarHBondContact O-N 3.46Å; Y54-D57 VanDerWaalsContact O-N 3.16Å; D57-E60 PolarHBondContact O-N 2.95Å; D57-T61 PolarHBondContact O-N 2.99Å; D57-T61 PolarHBondContact O-OG1 3.37Å
58D96.8Very high93.8Very high100 Ų10094.2 Ų94.254%0.53548%0.476SS..Hα-helixtrans-61.4-43170.5-75.1-16.2000111.5Y54 T61 I62Y54-D58 WeakPolarHBondContact O-CB 3.49Å; Y54-D58 PolarHBondContact O-N 3.28Å; D58-T61 WeakPolarHBondContact O-CB 3.47Å; D58-T61 PolarHBondContact O-N 3.04Å; D58-I62 WeakPolarHBondContact O-CG1 3.33Å; D58-I62 PolarHBondContact O-N 3.05Å
59Y97.9Very high94.4Very high141 Ų14196 Ų9655%0.55348%0.482SS*.Hα-helixtrans-59.8-47.2177170.1-95.6000112.3I55 R56 T61 I62 K63I55-Y59 WeakPolarHBondContact O-CB 3.43Å; I55-Y59 PolarHBondContact O-N 3.04Å; R56-Y59 WeakPolarHBondContact O-CB 3.48Å; R56-Y59 PolarHBondContact O-N 3.34Å; Y59-T61 VanDerWaalsContact C-N 3.28Å; Y59-T61 PolarHBondContact O-N 3.4Å; Y59-I62 PolarHBondContact O-N 2.95Å; Y59-K63 HydrophobicContact CE1-CD 4.1Å; Y59-K63 WeakPolarHBondContact O-CB 3.37Å; Y59-K63 PolarHBondContact O-N 3.13Å
60E97.6Very high94.9Very high93 Ų9398.2 Ų98.244%0.43548%0.484SS..Hα-helixtrans-66.4-33.1177.6-70.2-59.7150.500111.7R56 D57 K63 H64R56-E60 PolarHBondContact O-N 3.19Å; D57-E60 PolarHBondContact O-N 2.95Å; E60-K63 PolarHBondContact O-N 3.47Å; E60-K63 IonicContact OE1-NZ 2.95Å; E60-K63 PolarHBondContact OE1-NZ 3.38Å; E60-K63 IonicContact OE2-NZ 3.37Å; E60-K63 PolarHBondContact OE2-NZ 3.49Å; E60-H64 WeakPolarHBondContact O-CB 3.34Å; E60-H64 PolarHBondContact O-N 3Å
61T97.9Very high95.4Very high75 Ų7597.7 Ų97.746%0.4649%0.488SS..Hα-helixtrans-63.7-50.6173.7-58.60000111.6D57 D58 Y59 K63 H64 E65D57-T61 PolarHBondContact O-N 2.99Å; D57-T61 PolarHBondContact O-OG1 3.37Å; D58-T61 WeakPolarHBondContact O-CB 3.47Å; D58-T61 PolarHBondContact O-N 3.04Å; Y59-T61 VanDerWaalsContact C-N 3.28Å; Y59-T61 PolarHBondContact O-N 3.4Å; T61-K63 VanDerWaalsContact C-N 3.29Å; T61-K63 PolarHBondContact O-N 2.98Å; T61-H64 WeakPolarHBondContact O-CB 3.44Å; T61-H64 PolarHBondContact O-N 3.34Å; T61-H64 VanDerWaalsContact O-N 3.13Å; T61-E65 PolarHBondContact O-N 3.23Å
62I98Very high95.7Very high112 Ų11297.8 Ų97.857%0.57449%0.489SS*.Hα-helixtrans-59.2-42.5177.9-69.9165.9000110.9D58 Y59 H64 E65 L66D58-I62 WeakPolarHBondContact O-CG1 3.33Å; D58-I62 PolarHBondContact O-N 3.05Å; Y59-I62 PolarHBondContact O-N 2.95Å; I62-H64 VanDerWaalsContact C-N 3.33Å; I62-H64 PolarHBondContact O-N 3.43Å; I62-E65 PolarHBondContact O-N 2.95Å; I62-L66 WeakPolarHBondContact O-CB 3.49Å; I62-L66 PolarHBondContact O-N 3.37Å
63K98.1Very high95.8Very high103 Ų10398.7 Ų98.745%0.44849%0.485SS..Hα-helixtrans-63.1-39.6177.8179.8178.8161-1550111.9Y59 E60 T61 S67Y59-K63 HydrophobicContact CE1-CD 4.1Å; Y59-K63 WeakPolarHBondContact O-CB 3.37Å; Y59-K63 PolarHBondContact O-N 3.13Å; E60-K63 PolarHBondContact O-N 3.47Å; E60-K63 IonicContact OE1-NZ 2.95Å; E60-K63 PolarHBondContact OE1-NZ 3.38Å; E60-K63 IonicContact OE2-NZ 3.37Å; E60-K63 PolarHBondContact OE2-NZ 3.49Å; T61-K63 VanDerWaalsContact C-N 3.29Å; T61-K63 PolarHBondContact O-N 2.98Å; K63-S67 PolarHBondContact O-N 3.2Å
64H98.3Very high95.9Very high127 Ų127100.4 Ų100.459%0.58849%0.488SS*.Hα-helixtrans-64-50.2174.2178.369.5000111.7E60 T61 I62 L66 S67 V68E60-H64 WeakPolarHBondContact O-CB 3.34Å; E60-H64 PolarHBondContact O-N 3Å; T61-H64 WeakPolarHBondContact O-CB 3.44Å; T61-H64 PolarHBondContact O-N 3.34Å; T61-H64 VanDerWaalsContact O-N 3.13Å; I62-H64 VanDerWaalsContact C-N 3.33Å; I62-H64 PolarHBondContact O-N 3.43Å; H64-L66 VanDerWaalsContact C-N 3.32Å; H64-L66 PolarHBondContact O-N 3.4Å; H64-S67 WeakPolarHBondContact O-CA 3.34Å; H64-S67 VanDerWaalsContact O-CB 3.27Å; H64-S67 WeakPolarHBondContact O-CB 3.32Å; H64-S67 PolarHBondContact O-N 3.44Å; H64-V68 PolarHBondContact O-N 2.9Å
65E98.4Very high96Very high112 Ų11299.6 Ų99.652%0.52349%0.492SS..Hα-helixtrans-60.5-40.8179.4-70.5-174.6174.600112.2T61 I62 S67 V68 I69T61-E65 PolarHBondContact O-N 3.23Å; I62-E65 PolarHBondContact O-N 2.95Å; E65-S67 VanDerWaalsContact C-N 3.27Å; E65-S67 PolarHBondContact O-N 3.24Å; E65-V68 WeakPolarHBondContact O-CB 3.36Å; E65-V68 PolarHBondContact O-N 3.47Å; E65-V68 VanDerWaalsContact O-N 3.12Å; E65-I69 WeakPolarHBondContact O-CG1 3.27Å; E65-I69 PolarHBondContact O-N 2.88Å
66L97.7Very high96Very high90 Ų9096.9 Ų96.947%0.47149%0.485SS..Hα-helixtrans-59.4-39174.4-178.862.6000111.9I62 H64 I69 K70I62-L66 WeakPolarHBondContact O-CB 3.49Å; I62-L66 PolarHBondContact O-N 3.37Å; H64-L66 VanDerWaalsContact C-N 3.32Å; H64-L66 PolarHBondContact O-N 3.4Å; L66-I69 PolarHBondContact O-N 3.44Å; L66-K70 HydrophobicContact CG-CD 4.5Å; L66-K70 WeakPolarHBondContact O-CB 3.41Å; L66-K70 VanDerWaalsContact O-CG 3.32Å; L66-K70 WeakPolarHBondContact O-CG 3.5Å; L66-K70 PolarHBondContact O-N 2.9Å
67S97.4Very high95.9Very high75 Ų7592.2 Ų92.252%0.52447%0.468SS..Hα-helixtrans-63.9-42.4174.9-170.50000111.7K63 H64 E65 K70 A71K63-S67 PolarHBondContact O-N 3.2Å; H64-S67 WeakPolarHBondContact O-CA 3.34Å; H64-S67 VanDerWaalsContact O-CB 3.27Å; H64-S67 WeakPolarHBondContact O-CB 3.32Å; H64-S67 PolarHBondContact O-N 3.44Å; E65-S67 VanDerWaalsContact C-N 3.27Å; E65-S67 PolarHBondContact O-N 3.24Å; S67-K70 PolarHBondContact O-N 3.04Å; S67-A71 PolarHBondContact O-N 3.34Å
68V97.9Very high95.8Very high60 Ų6092.7 Ų92.736%0.36447%0.47SS..Hα-helixtrans-63.9-44.9177174.20000111.1H64 E65 K70 A71 N72H64-V68 PolarHBondContact O-N 2.9Å; E65-V68 WeakPolarHBondContact O-CB 3.36Å; E65-V68 PolarHBondContact O-N 3.47Å; E65-V68 VanDerWaalsContact O-N 3.12Å; V68-K70 VanDerWaalsContact C-N 3.34Å; V68-K70 PolarHBondContact O-N 3.5Å; V68-A71 PolarHBondContact O-N 3.02Å; V68-N72 WeakPolarHBondContact O-CB 3.37Å; V68-N72 PolarHBondContact O-N 3.36Å
69I96.6Very high95.7Very high107 Ų10790.8 Ų90.855%0.54947%0.468SS..Hα-helixtrans-60.8-44177.4-69.1166.1000110.8E65 L66 A71 N72 R73E65-I69 WeakPolarHBondContact O-CG1 3.27Å; E65-I69 PolarHBondContact O-N 2.88Å; L66-I69 PolarHBondContact O-N 3.44Å; I69-A71 PolarHBondContact O-N 2.92Å; I69-N72 PolarHBondContact O-N 3Å; I69-R73 VanDerWaalsContact O-CB 3.31Å; I69-R73 WeakPolarHBondContact O-CB 3.45Å; I69-R73 PolarHBondContact O-N 3.18Å
70K94.9Very high95.5Very high110 Ų11087.7 Ų87.748%0.47846%0.461SS..Hα-helixtrans-60.2-43.9176.3-76.3177.2177.8-175.40111.9L66 S67 V68 R73 Q74L66-K70 HydrophobicContact CG-CD 4.5Å; L66-K70 WeakPolarHBondContact O-CB 3.41Å; L66-K70 VanDerWaalsContact O-CG 3.32Å; L66-K70 WeakPolarHBondContact O-CG 3.5Å; L66-K70 PolarHBondContact O-N 2.9Å; S67-K70 PolarHBondContact O-N 3.04Å; V68-K70 VanDerWaalsContact C-N 3.34Å; V68-K70 PolarHBondContact O-N 3.5Å; K70-R73 PolarHBondContact O-N 3.12Å; K70-Q74 PolarHBondContact O-N 3.41Å
71A95.7Very high95.2Very high51 Ų5186.6 Ų86.642%0.42146%0.458SS..Hα-helixtrans-63.8-47176.900000112S67 V68 I69 R73 Q74 I75S67-A71 PolarHBondContact O-N 3.34Å; V68-A71 PolarHBondContact O-N 3.02Å; I69-A71 PolarHBondContact O-N 2.92Å; A71-R73 VanDerWaalsContact C-N 3.31Å; A71-R73 PolarHBondContact O-N 2.9Å; A71-Q74 WeakPolarHBondContact O-CB 3.5Å; A71-Q74 PolarHBondContact O-N 3.39Å; A71-Q74 VanDerWaalsContact O-N 3.14Å; A71-I75 WeakPolarHBondContact O-CG1 3.31Å; A71-I75 PolarHBondContact O-N 2.97Å
72N96Very high95Very high96 Ų9687.3 Ų87.351%0.51347%0.472SS..Hα-helixtrans-62.6-39178.1-73-14000112.1V68 I69 Q74 I75 A76V68-N72 WeakPolarHBondContact O-CB 3.37Å; V68-N72 PolarHBondContact O-N 3.36Å; I69-N72 PolarHBondContact O-N 3Å; N72-Q74 VanDerWaalsContact C-N 3.34Å; N72-I75 PolarHBondContact O-N 3.14Å; N72-A76 WeakPolarHBondContact O-CB 3.45Å; N72-A76 PolarHBondContact O-N 3.4Å
73R92.4Very high94.8Very high126 Ų12685.3 Ų85.348%0.47547%0.472SS..Hα-helixtrans-61.1-43.4173.9-176.2-177.568.8158.62.9111.4I69 K70 A71 A76 R77 D90I69-R73 VanDerWaalsContact O-CB 3.31Å; I69-R73 WeakPolarHBondContact O-CB 3.45Å; I69-R73 PolarHBondContact O-N 3.18Å; K70-R73 PolarHBondContact O-N 3.12Å; A71-R73 VanDerWaalsContact C-N 3.31Å; A71-R73 PolarHBondContact O-N 2.9Å; R73-A76 PolarHBondContact O-N 2.87Å; R73-R77 WeakPolarHBondContact O-CB 3.39Å; R73-R77 PolarHBondContact O-N 3.42Å; R73-D90 VanDerWaalsContact CZ-CG 3.45Å; R73-D90 IonicContact CZ-OD1 2.98Å; R73-D90 IonicContact CZ-OD2 3.22Å; R73-D90 IonicContact NE-OD1 3.82Å; R73-D90 IonicContact NE-OD2 3.82Å; R73-D90 IonicContact NH1-OD1 2.7Å; R73-D90 PolarHBondContact NH1-OD1 3.3Å; R73-D90 IonicContact NH1-OD2 3.76Å; R73-D90 IonicContact NH2-OD1 3.08Å; R73-D90 PolarHBondContact NH2-OD1 3.34Å; R73-D90 VanDerWaalsContact NH2-OD1 3.08Å; R73-D90 IonicContact NH2-OD2 2.64Å; R73-D90 PolarHBondContact NH2-OD2 3.2Å
74Q91.1Very high94.6Very high74 Ų7483.6 Ų83.635%0.34648%0.483SS..Hα-helixtrans-62.1-46177.1-173.761.947.100111.3K70 A71 N72 A76 R77 D78K70-Q74 PolarHBondContact O-N 3.41Å; A71-Q74 WeakPolarHBondContact O-CB 3.5Å; A71-Q74 PolarHBondContact O-N 3.39Å; A71-Q74 VanDerWaalsContact O-N 3.14Å; N72-Q74 VanDerWaalsContact C-N 3.34Å; Q74-A76 VanDerWaalsContact C-N 3.32Å; Q74-A76 PolarHBondContact O-N 3.04Å; Q74-R77 WeakPolarHBondContact O-CB 3.5Å; Q74-R77 PolarHBondContact O-N 3.44Å; Q74-D78 PolarHBondContact NE2-OD1 3.03Å; Q74-D78 VanDerWaalsContact O-CG 3.24Å; Q74-D78 PolarHBondContact O-N 3.35Å
75I94.2Very high94.3Very high112 Ų11283.9 Ų83.957%0.57448%0.483SS*.Hα-helixtrans-57.9-45.3176.5-66.8165.8000111.1A71 N72 D78 A79A71-I75 WeakPolarHBondContact O-CG1 3.31Å; A71-I75 PolarHBondContact O-N 2.97Å; N72-I75 PolarHBondContact O-N 3.14Å; I75-D78 PolarHBondContact O-N 3.42Å; I75-A79 PolarHBondContact O-N 2.85Å
76A92.9Very high93.6Very high51 Ų5187.9 Ų87.942%0.42150%0.501SS..Hα-helixtrans-63.6-41.217800000112.1N72 R73 Q74 A79 L80N72-A76 WeakPolarHBondContact O-CB 3.45Å; N72-A76 PolarHBondContact O-N 3.4Å; R73-A76 PolarHBondContact O-N 2.87Å; Q74-A76 VanDerWaalsContact C-N 3.32Å; Q74-A76 PolarHBondContact O-N 3.04Å; A76-A79 PolarHBondContact O-N 3.48Å; A76-L80 WeakPolarHBondContact O-CG 3.35Å; A76-L80 PolarHBondContact O-N 2.95Å
77R90.8Very high92.6Very high52 Ų5285.5 Ų85.520%0.19649%0.492CS..Hα-helixtrans-61-47.2175.3-178178.2-177.4-92.41.8111.5R73 Q74 A79 L80 L81 C87 D89R73-R77 WeakPolarHBondContact O-CB 3.39Å; R73-R77 PolarHBondContact O-N 3.42Å; Q74-R77 WeakPolarHBondContact O-CB 3.5Å; Q74-R77 PolarHBondContact O-N 3.44Å; R77-A79 VanDerWaalsContact C-N 3.3Å; R77-A79 PolarHBondContact O-N 3.38Å; R77-L80 PolarHBondContact O-N 3.4Å; R77-L81 HydrophobicContact CG-CD1 4.08Å; R77-L81 WeakPolarHBondContact O-CG 3.46Å; R77-L81 PolarHBondContact O-N 2.95Å; R77-C87 HydrophobicContact CG-CB 4.11Å; R77-D89 IonicContact CZ-OD1 3.78Å; R77-D89 IonicContact NH2-OD1 2.69Å; R77-D89 PolarHBondContact NH2-OD1 2.99Å
78D91.6Very high91.6Very high79 Ų7987.2 Ų87.242%0.42250%0.501SS..Hα-helixtrans-62.3-39.9-179.9-65.5-18.4000111.2Q74 I75 L81 A82Q74-D78 PolarHBondContact NE2-OD1 3.03Å; Q74-D78 VanDerWaalsContact O-CG 3.24Å; Q74-D78 PolarHBondContact O-N 3.35Å; I75-D78 PolarHBondContact O-N 3.42Å; D78-L81 PolarHBondContact O-N 3.41Å; D78-A82 WeakPolarHBondContact O-CB 3.47Å; D78-A82 PolarHBondContact O-N 3.23Å
79A94.1Very high90.3Very high60 Ų6090.8 Ų90.850%0.49652%0.518SS..Hα-helixtrans-64.6-42175.200000112.7I75 A76 R77 A82 A83I75-A79 PolarHBondContact O-N 2.85Å; A76-A79 PolarHBondContact O-N 3.48Å; R77-A79 VanDerWaalsContact C-N 3.3Å; R77-A79 PolarHBondContact O-N 3.38Å; A79-A82 PolarHBondContact O-N 2.64Å; A79-A83 WeakPolarHBondContact O-CB 3.48Å; A79-A83 PolarHBondContact O-N 3.08Å
80L93.1Very high88.9Confident76 Ų7689 Ų8940%0.39851%0.51SS..Hα-helixtrans-65.1-43.2177-74.5170.2000111.9A76 R77 A83 G84 F85A76-L80 WeakPolarHBondContact O-CG 3.35Å; A76-L80 PolarHBondContact O-N 2.95Å; R77-L80 PolarHBondContact O-N 3.4Å; L80-A83 CarbonylContact O-C 3.59Å; L80-A83 PolarHBondContact O-N 2.7Å; L80-G84 PolarHBondContact O-N 2.93Å; L80-F85 HydrophobicContact CB-CB 4.35Å; L80-F85 HydrophobicContact CD2-CD2 4.06Å; L80-F85 HydrophobicContact CD2-CG 4.41Å; L80-F85 WeakPolarHBondContact O-CB 3.37Å; L80-F85 PolarHBondContact O-N 3.47Å
81L91.6Very high87.6Confident70 Ų7088.6 Ų88.637%0.36652%0.518SS..Hα-helixtrans-62-43.1175.1-71.7170.7000111.4R77 D78 A83 G84 C87R77-L81 HydrophobicContact CG-CD1 4.08Å; R77-L81 WeakPolarHBondContact O-CG 3.46Å; R77-L81 PolarHBondContact O-N 2.95Å; D78-L81 PolarHBondContact O-N 3.41Å; L81-A83 PolarHBondContact O-N 3.02Å; L81-G84 PolarHBondContact O-N 2.69Å; L81-C87 HydrophobicContact CD2-CB 4.1Å; L81-C87 HydrophobicContact CG-CB 4.3Å
82A93.4Very high86.2Confident91 Ų9192.3 Ų92.375%0.75254%0.539SS*.Hα-helixtrans-63.4-29.5176.200000112.9D78 A79 G84D78-A82 WeakPolarHBondContact O-CB 3.47Å; D78-A82 PolarHBondContact O-N 3.23Å; A79-A82 PolarHBondContact O-N 2.64Å; A82-G84 VanDerWaalsContact C-N 3.25Å; A82-G84 PolarHBondContact O-N 3.03Å
83A95.4Very high84.7Confident70 Ų7097.7 Ų97.758%0.57958%0.575SS**THydrogen-bonded Turntrans-81.20.7173.500000113.8A79 L80 L81 F85A79-A83 WeakPolarHBondContact O-CB 3.48Å; A79-A83 PolarHBondContact O-N 3.08Å; L80-A83 CarbonylContact O-C 3.59Å; L80-A83 PolarHBondContact O-N 2.7Å; L81-A83 PolarHBondContact O-N 3.02Å; A83-F85 HydrophobicContact CB-CD2 3.89Å; A83-F85 HydrophobicContact CB-CE2 4.07Å
84G93.8Very high84.3Confident66 Ų6696.3 Ų96.368%0.6858%0.58SS**THydrogen-bonded Turntrans86.59.4176.800000115L80 L81 A82L80-G84 PolarHBondContact O-N 2.93Å; L81-G84 PolarHBondContact O-N 2.69Å; A82-G84 VanDerWaalsContact C-N 3.25Å; A82-G84 PolarHBondContact O-N 3.03Å
85F91.3Very high83.9Confident133 Ų13397.4 Ų97.458%0.58359%0.592SS**  trans-78.3141.8172.5-67.5-85000110.7L80 A83L80-F85 HydrophobicContact CB-CB 4.35Å; L80-F85 HydrophobicContact CD2-CD2 4.06Å; L80-F85 HydrophobicContact CD2-CG 4.41Å; L80-F85 WeakPolarHBondContact O-CB 3.37Å; L80-F85 PolarHBondContact O-N 3.47Å; A83-F85 HydrophobicContact CB-CD2 3.89Å; A83-F85 HydrophobicContact CB-CE2 4.07Å
86Q83.5Confident83.3Confident196 Ų19696.6 Ų96.692%0.91659%0.593SS**  trans-79.2122.8168.3-73.4-176.3-13.400109.4
87C77.4Confident82.8Confident40 Ų4099.3 Ų99.327%0.2760%0.603SS.*  trans-118.8119177.2-143.30000108.5R77 L81R77-C87 HydrophobicContact CG-CB 4.11Å; L81-C87 HydrophobicContact CD2-CB 4.1Å; L81-C87 HydrophobicContact CG-CB 4.3Å
88P75.6Confident82.3Confident112 Ų112102.3 Ų102.373%0.72763%0.629SS**PPolyproline II helixtrans-59.4147-179.622.3-30.1000110.9
89D71.8Confident81.7Confident134 Ų134103.8 Ų103.872%0.71764%0.642SS**PPolyproline II helixtrans-62.7149.9174.3-70.2-40.9000110.4R77R77-D89 IonicContact CZ-OD1 3.78Å; R77-D89 IonicContact NH2-OD1 2.69Å; R77-D89 PolarHBondContact NH2-OD1 2.99Å
90D66.6Low80.8Confident69 Ų69106.9 Ų106.937%0.36965%0.653SS.*PPolyproline II helixtrans-59.7137.9173.7-87.1-44.5000110.1R73R73-D90 VanDerWaalsContact CZ-CG 3.45Å; R73-D90 IonicContact CZ-OD1 2.98Å; R73-D90 IonicContact CZ-OD2 3.22Å; R73-D90 IonicContact NE-OD1 3.82Å; R73-D90 IonicContact NE-OD2 3.82Å; R73-D90 IonicContact NH1-OD1 2.7Å; R73-D90 PolarHBondContact NH1-OD1 3.3Å; R73-D90 IonicContact NH1-OD2 3.76Å; R73-D90 IonicContact NH2-OD1 3.08Å; R73-D90 PolarHBondContact NH2-OD1 3.34Å; R73-D90 VanDerWaalsContact NH2-OD1 3.08Å; R73-D90 IonicContact NH2-OD2 2.64Å; R73-D90 PolarHBondContact NH2-OD2 3.2Å
91P67.7Low79.8Confident102 Ų102109.3 Ų109.366%0.66267%0.672SS**PPolyproline II helixtrans-60.3142.5173.823.7-30.3000109.7T93P91-T93 PolarHBondContact O-N 3.04Å
92P66.1Low78.8Confident130 Ų130112.6 Ų112.684%0.84470%0.698SS**PPolyproline II helixtrans-58.2138.117723.4-31000109.8
93T63.5Low77.5Confident208 Ų208114.5 Ų114.5100%1.27669%0.693SS**  trans-78.80-178.1-27.60000111.4P91P91-T93 PolarHBondContact O-N 3.04Å

Retrieved 93 of 93 residues in 49.8 ms (Link to these results)